5-(2-dimethylaminoethyl)-6H-benzo[b][1]benzothiepine-5-carbonitrile

Systemtic Name: 5-(2-dimethylaminoethyl)-6H-benzo[b][1]benzothiepine-5-carbonitrile Openeye Name: 5-(2-dimethylaminoethyl)-6H-benzo[b][1]benzothiepine-5-carbonitrile CAS Name: 5-(2-dimethylaminoethyl)-6H-benzo[b][1]benzothiepin-5-carbonitrile IUPAC Name: 5-(2-dimethylaminoethyl)-6H-benzo[b][1]benzothiepine-5-carbonitrile Traditional Name: 5-(2-dimethylaminoethyl)-6H-benzo[b][1]benzothiepin-5-carbonitrile Formula: C19H20N2S MolecularWeight: 308.4405

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1(CC2=CC=CC=C2SC3=CC=CC=C31)C#N

Isomeric SMILES

CN(C)CCC1(CC2=CC=CC=C2SC3=CC=CC=C31)C#N

InChI

InChI=1S/C19H20N2S/c1-21(2)12-11-19(14-20)13-15-7-3-5-9-17(15)22-18-10-6-4-8-16(18)19/h3-10H,11-13H2,1-2H3